SCHEMBL7631342

SCHEMBL7631342

CC(=O)c1cc(F)cc(NC(=O)c2ccc3c(c2)CC(CCCc2ccccc2)O3)c1O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.42
MTNR1A P48039 6/20 0.38
MTNR1B P49286 6/20 0.38
PLK1 P53350 1/20 0.37
PLK3 Q9H4B4 1/20 0.37
AKR1B1 P15121 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7630394 0.89 RAB9A (0.48) RAB9AMTNR1AMTNR1BPLK1PLK3
SCHEMBL7633772 0.81 GPR35 (0.55)
SCHEMBL7634458 0.81 RAB9A (0.42) RAB9AMTNR1AMTNR1BPLK1PLK3
SCHEMBL7634210 0.77 GPR35 (0.57) RAB9A
SCHEMBL7626734 0.76 MTNR1A (0.40) MTNR1AMTNR1B
SCHEMBL7627993 0.76 TDP1 (0.52) MTNR1AMTNR1BAKR1B1ALDH1A1
SCHEMBL7633140 0.75 HSD17B13 (0.38) RAB9AMTNR1AMTNR1BPLK1PLK3
SCHEMBL7629779 0.75 RAB9A (0.52) RAB9AALDH1A1KMT2A
SCHEMBL7626547 0.75 RAB9A (0.47) RAB9AALDH1A1KMT2A
SCHEMBL8320224 0.74 GPR35 (0.41) RAB9AMTNR1AMTNR1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0888327-B1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION MENARINI LAB (ES) 2002-06-12 EP disclosed
US-5990142-A ANTIINFLAMMATORY AGENTS AND ANTIALLERGENS HAVING GOOD ORAL ADSORPTION AND BIOAVAILABILITY; CARDIOTONIC AND ANTIISCHEMIC AGENTS LABORATORIOS MENARINI S.A. (ES) 1999-11-23 US disclosed
EP-0888327-A1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1999-01-07 EP disclosed
WO-1997034885-A1 BENZOPYRAN DERIVATIVES HAVING LEUKOTRIENE-ANTAGONISTIC ACTION LABORATORIOS MENARINI S.A. (ES) 1997-09-25 WO disclosed